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Screening compounds

Dabequin

Also known as 1,2-Ethanediamine, N'-benzo(g)quinolin-4-yl-N,N-diethyl-, phosphate (1:2), N-benzo[g]quinolin-4-yl-N',N'-diethylethane-1,2-diamine, phosphoric acid, Dabequin phosphate

CAS 56548-51-7Formula C19H29N3O8P2Molar mass 489.40 g/mol
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Dabequin chemical structure, C19H29N3O8P2, CAS 56548-51-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
56548-51-7
Formula
C19H29N3O8P2
Molar mass
489.40 g/mol
HS code
293399
Category
Screening compounds

What is Dabequin?

Plain description, key identifiers and synonyms

Dabequin is a chemical substance with the molecular formula C19H29N3O8P2 and a molar mass of 489.40 g/mol. Its CAS registry number is 56548-51-7. The IUPAC name is N-benzo[g]quinolin-4-yl-N',N'-diethylethane-1,2-diamine, phosphoric acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-benzo[g]quinolin-4-yl-N',N'-diethylethane-1,2-diamine, phosphoric acid
CAS number
56548-51-7 CAS number cross-checked
Molecular formula
C19H29N3O8P2
InChIKey
NRIPPNSZXMSXSL-UHFFFAOYSA-N
InChI
InChI=1S/C19H23N3.2H3O4P/c1-3-22(4-2)12-11-21-18-9-10-20-19-14-16-8-6-5-7-15(16)13-17(18)19;2*1-5(2,3)4/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,20,21);2*(H3,1,2,3,4)
SMILES (canonical and isomeric)
CCN(CC)CCNC1=CC=NC2=CC3=CC=CC=C3C=C12.OP(=O)(O)O.OP(=O)(O)O

Synonyms

  • 1,2-Ethanediamine, N'-benzo(g)quinolin-4-yl-N,N-diethyl-, phosphate (1:2)
  • N-benzo[g]quinolin-4-yl-N',N'-diethylethane-1,2-diamine, phosphoric acid
  • Dabequin phosphate
  • Dabequin (phosphate)
  • Triethylamine, 2-(benzo(g)quinolin-4-ylamino)-, diphosphate
  • N'-Benzo[g]quinolin-4-yl-N,N-diethyl-1,2-ethanediamine bis(phosphate)
  • N1-(benzo[g]quinolin-4-yl)-N2,N2-diethylethane-1,2-diamine bis(phosphate)
  • [2-(benzo[g]quinolin-4-ylamino)ethyl]diethylamine, phosphoric acid, phosphoric acid
  • Phosphoric acid--N~2~-(benzo[g]quinolin-4-yl)-N~1~,N~1~-diethylethane-1,2-diamine (2/1)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
489.40 g/molcalc.
Exact mass
489.143 Dacalc.
LogP (octanol/water)
2.28calc.
Topological polar surface area
183.7 Ųcalc.
Hydrogen bond donors
7calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
6calc.
Heavy atoms
32calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.32calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
3calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc2cc3ncccc3cc2c1

c1ccc2cc3ncccc3cc2c1

3 rings, 14 atoms, the Benzo[g]quinoline ring system.

14 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Dabequin suppliers

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Dabequin price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Dabequin is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Dabequin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Dabequin, based on the data on this page

What is Dabequin?

Dabequin is a chemical substance with the molecular formula C19H29N3O8P2 and a molar mass of 489.40 g/mol. Its CAS registry number is 56548-51-7. The IUPAC name is N-benzo[g]quinolin-4-yl-N',N'-diethylethane-1,2-diamine, phosphoric acid.

What is the CAS number of Dabequin?

The CAS registry number of Dabequin is 56548-51-7.

What is the molecular formula and weight of Dabequin?

The molecular formula of Dabequin is C19H29N3O8P2 and its molar mass is 489.40 g/mol.

What is Dabequin used for?

Known uses and roles of Dabequin include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Dabequin hazardous?

No GHS hazard classification for Dabequin is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Dabequin?

Dabequin is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Dabequin?

Post a free request on CompoundList and suppliers of Dabequin will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Dabequin?

Suppliers quote Dabequin on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Dabequin

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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